Changeset 1513599 for ThirdParty/mpqc_open/src/lib/chemistry/qc
- Timestamp:
- Mar 2, 2017, 12:28:37 PM (8 years ago)
- Branches:
- Action_Thermostats, Add_AtomRandomPerturbation, Add_RotateAroundBondAction, Add_SelectAtomByNameAction, Adding_Graph_to_ChangeBondActions, Adding_MD_integration_tests, Adding_StructOpt_integration_tests, AutomationFragmentation_failures, Candidate_v1.6.0, Candidate_v1.6.1, ChangeBugEmailaddress, ChangingTestPorts, ChemicalSpaceEvaluator, Combining_Subpackages, Debian_Package_split, Debian_package_split_molecuildergui_only, Disabling_MemDebug, Docu_Python_wait, EmpiricalPotential_contain_HomologyGraph_documentation, Enable_parallel_make_install, Enhance_userguide, Enhanced_StructuralOptimization, Enhanced_StructuralOptimization_continued, Example_ManyWaysToTranslateAtom, Exclude_Hydrogens_annealWithBondGraph, FitPartialCharges_GlobalError, Fix_ChronosMutex, Fix_StatusMsg, Fix_StepWorldTime_single_argument, Fix_Verbose_Codepatterns, ForceAnnealing_goodresults, ForceAnnealing_oldresults, ForceAnnealing_tocheck, ForceAnnealing_with_BondGraph, ForceAnnealing_with_BondGraph_continued, ForceAnnealing_with_BondGraph_continued_betteresults, ForceAnnealing_with_BondGraph_contraction-expansion, GeometryObjects, Gui_displays_atomic_force_velocity, IndependentFragmentGrids_IntegrationTest, JobMarket_RobustOnKillsSegFaults, JobMarket_StableWorkerPool, JobMarket_unresolvable_hostname_fix, ODR_violation_mpqc_open, PartialCharges_OrthogonalSummation, PythonUI_with_named_parameters, QtGui_reactivate_TimeChanged_changes, Recreated_GuiChecks, RotateToPrincipalAxisSystem_UndoRedo, StoppableMakroAction, Subpackage_levmar, Subpackage_vmg, ThirdParty_MPQC_rebuilt_buildsystem, TremoloParser_IncreasedPrecision, TremoloParser_MultipleTimesteps, Ubuntu_1604_changes, stable
- Children:
- 72461c
- Parents:
- 6b1a6a
- git-author:
- Frederik Heber <heber@…> (02/09/17 15:48:12)
- git-committer:
- Frederik Heber <heber@…> (03/02/17 12:28:37)
- Location:
- ThirdParty/mpqc_open/src/lib/chemistry/qc
- Files:
-
- 9 edited
Legend:
- Unmodified
- Added
- Removed
-
ThirdParty/mpqc_open/src/lib/chemistry/qc/basis/Makefile.am
r6b1a6a r1513599 95 95 btest 96 96 97 TESTS += $(BASISTESTS) 97 98 check_PROGRAMS += $(BASISTESTS) 98 99 noinst_PROGRAMS += $(BASISTESTS) -
ThirdParty/mpqc_open/src/lib/chemistry/qc/cints/Makefile.am
r6b1a6a r1513599 87 87 cintstest 88 88 89 TESTS += $(CINTSTESTS) 89 90 check_PROGRAMS += $(CINTSTESTS) 90 91 noinst_PROGRAMS += $(CINTSTESTS) -
ThirdParty/mpqc_open/src/lib/chemistry/qc/dft/Makefile.am
r6b1a6a r1513599 64 64 lebedev 65 65 66 TESTS += $(DFTTESTS) 66 67 check_PROGRAMS += $(DFTTESTS) 67 68 noinst_PROGRAMS += $(DFTTESTS) -
ThirdParty/mpqc_open/src/lib/chemistry/qc/intv3/Makefile.am
r6b1a6a r1513599 82 82 inttest 83 83 84 TESTS += $(INTV3TESTS) 84 85 check_PROGRAMS += $(INTV3TESTS) 85 86 noinst_PROGRAMS += $(INTV3TESTS) -
ThirdParty/mpqc_open/src/lib/chemistry/qc/mbpt/Makefile.am
r6b1a6a r1513599 70 70 mbpttest 71 71 72 TESTS += $(MBPTTESTS) 72 73 check_PROGRAMS += $(MBPTTESTS) 73 74 noinst_PROGRAMS += $(MBPTTESTS) -
ThirdParty/mpqc_open/src/lib/chemistry/qc/mbptr12/Makefile.am
r6b1a6a r1513599 120 120 mbptr12test 121 121 122 TESTS += $(MBPTR12TESTS) 122 123 check_PROGRAMS += $(MBPTR12TESTS) 123 124 noinst_PROGRAMS += $(MBPTR12TESTS) -
ThirdParty/mpqc_open/src/lib/chemistry/qc/psi/Makefile.am
r6b1a6a r1513599 56 56 psitest 57 57 58 TESTS += $(PSITESTS) 58 59 check_PROGRAMS += $(PSITESTS) 59 60 noinst_PROGRAMS += $(PSITESTS) -
ThirdParty/mpqc_open/src/lib/chemistry/qc/scf/Makefile.am
r6b1a6a r1513599 89 89 scftest 90 90 91 TESTS += $(SCFTESTS) 91 92 check_PROGRAMS += $(SCFTESTS) 92 93 noinst_PROGRAMS += $(SCFTESTS) -
ThirdParty/mpqc_open/src/lib/chemistry/qc/wfn/Makefile.am
r6b1a6a r1513599 66 66 wfntest 67 67 68 TESTS += $(WFNTESTS) 68 69 check_PROGRAMS += $(WFNTESTS) 69 70 noinst_PROGRAMS += $(WFNTESTS)
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